5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylic acid

Systemtic Name: 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxidanylidene-pyridazine-3-carboxylic acid Openeye Name: 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-pyridazine-3-carboxylic acid CAS Name: 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxo-3-pyridazinecarboxylic acid IUPAC Name: 5-cyano-1-(4-methoxyphenyl)-4-methyl-6-oxopyridazine-3-carboxylic acid Traditional Name: 5-cyano-6-keto-1-(4-methoxyphenyl)-4-methyl-pyridazine-3-carboxylic acid Formula: C14H11N3O4 MolecularWeight: 285.25484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C(=O)O)C2=CC=C(C=C2)OC)C#N

Isomeric SMILES

CC1=C(C(=O)N(N=C1C(=O)O)C2=CC=C(C=C2)OC)C#N

InChI

InChI=1S/C14H11N3O4/c1-8-11(7-15)13(18)17(16-12(8)14(19)20)9-3-5-10(21-2)6-4-9/h3-6H,1-2H3,(H,19,20)